In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 11th, 2008 | 34 | No |
Popular Name: 3-[(2R)-2-(4-acetamidophenyl)-3-benzoyl-4-hydroxy-5-oxo-2H-pyrrol-1-yl]benzoic 3-[(2R)-2-(4-acetamidophenyl)-3-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.18 | 10.13 | -146.16 | 1 | 8 | -2 | 130 | 454.438 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.63 | 8.14 | -89.19 | 2 | 8 | -1 | 127 | 455.446 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.60 | 9.19 | -74.02 | 1 | 8 | -1 | 124 | 455.446 | 6 | ↓ |